SCHEMBL192001

SCHEMBL192001

CCCc1cc(C)ccc1C1(C)NC(=O)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.44
PTGER3 P43115 1/20 0.39
LMNA P02545 1/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
APOBEC3A P31941 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
ADAMTS5 Q9UNA0 1/20 0.35
TSHR P16473 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ADAM17 P78536 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29688609 0.76 AKR1B1 (0.44) AKR1B1PTGER3LMNA
SCHEMBL20135344 0.76 AKR1B1 (0.44) AKR1B1PTGER3LMNA
SCHEMBL15974325 0.74 LMNA (0.47) AKR1B1PTGER3LMNA
SCHEMBL15972677 0.71 LMNA (0.47) AKR1B1PTGER3LMNAKDM4EALDH1A1
SCHEMBL542561 0.68 LMNA (0.53) AKR1B1LMNAHSD17B10ALDH1A1MAPT
SCHEMBL20134878 0.68 LMNA (0.53) AKR1B1LMNAHSD17B10ALDH1A1MAPT
SCHEMBL10822849 0.66 TAAR1 (0.43) KDM4EHSD17B10APOBEC3ACTDSP1APOBEC3G
SCHEMBL6099453 0.66 LMNA (0.51) LMNAALDH1A1MAPTADAMTS5MEN1
SCHEMBL9629541 0.65 TAAR1 (0.42) KDM4EHSD17B10APOBEC3ACTDSP1APOBEC3G
SCHEMBL20135216 0.65 PTGER3 (0.40) AKR1B1PTGER3LMNAMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2401261-A1 N-PHENYLACETAMIDE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1 AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM Galderma Research & Development (FR) 2012-01-04 EP disclosed
WO-2010097467-A1 N-PHENYLACETAMIDE DERIVATIVES, WHICH INHIBIT THE ENZYME SOAT-1 AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING THEM GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-09-02 WO disclosed